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Table 3 Average recall for different data sets.

From: Application of kernel functions for accurate similarity search in large chemical databases

Dataset

G-hash

WA

C-tree

Fingerprint

gIndex

PDE5

73.19

58.06

46.93

58.80

73.60*

CDK2

67.17

55.87

46.70

47.20

67.82*

COX2

64.22

63.57

51.46

54.21

87.01*

FXa

64.63

58.23

42.06

55.62

71.19*

AIA

80.70*

64.81

55.33

54.41

60.20

AChE

76.13

63.63

44.15

27.40

85.20*

ALF

69.84

61.25

53.83

75.98*

65.00

EGF-R

86.22*

79.64

55.81

54.00

81.61

HIV-P

80.44*

63.4

47.62

42.20

75.40

HSP90

76.31

63.4

47.62

71.00

91.38*

MAPK

86.83*

70.52

72.16

42.01

85.79

HIV-RT

72.83

67.78

56.78

60.80

73.40*

  1. Asterisk (*) denotes the best recall for the data sets among G-hash, WA, C-tree ,Daylight fingerprint and gIndex methods.